SCHEMBL24458475

SCHEMBL24458475

C=CC(=O)N1CC[C@@H](N2CC(C#Cc3c(-c4ccc(Cl)c(OC)n4)c4c(N)ncnc4n3C)C2)[C@@H](O)C1

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ FGFR2 P21802 9/20 0.42
▸ FGFR1 P11362 7/20 0.40
▸ FGFR4 P22455 7/20 0.40
▸ BTK Q06187 5/20 0.39
▸ KDR P35968 3/20 0.39
▸ FGFR3 P22607 2/20 0.39
▸ EGFR P00533 1/20 0.39
▸ ITK Q08881 1/20 0.37

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL29552790 1.00 FGFR2 (0.42) FGFR2FGFR1FGFR4BTKKDR
SCHEMBL31523873 0.93 FGFR2 (0.43) FGFR2FGFR1FGFR4BTKKDR
SCHEMBL24459159 0.93 FGFR2 (0.43) FGFR2FGFR1FGFR4BTKKDR
SCHEMBL31523855 0.91 FGFR2 (0.47) FGFR2FGFR1FGFR4BTKKDR
SCHEMBL24458612 0.91 FGFR2 (0.47) FGFR2FGFR1FGFR4BTKKDR
SCHEMBL24458673 0.89 BTK (0.42) FGFR2BTKKDREGFRITK
SCHEMBL31523950 0.89 BTK (0.42) FGFR2BTKKDREGFRITK
SCHEMBL24458378 0.89 FGFR1 (0.42) FGFR2FGFR1FGFR4BTKKDR
SCHEMBL31523821 0.88 EGFR (0.41) FGFR2FGFR1FGFR4BTKKDR
SCHEMBL24458990 0.88 EGFR (0.41) FGFR2FGFR1FGFR4BTKKDR

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022109551-A1 SRC INHIBITORS AND USES THEREOF RELAY THERAPEUTICS, INC. (US) 2022-05-27 — — WO disclosed
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